A theoretical analysis of a classic example of supramolecular catalysis

被引：54

作者：

Carlqvist, Peter

Maseras, Feliu

机构：

[1] Inst Chem Res Catalonia ICIQ, Tarragona 43007, Catalonia, Spain

[2] Univ Autonoma Barcelona, Unitat Quim Fis, Bellaterra 08193, Catalonia, Spain

来源：

CHEMICAL COMMUNICATIONS | 2007年 / 07期

关键词：

D O I：

10.1039/b613434c

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Computational chemistry is used to study a 1,3-dipolar cycloaddition between an azide and an alkyne inside the macrocycle cucurbit[6]uril, in order to elucidate the catalytic function of a highly efficient supramolecular catalyst.

引用

页码：748 / 750

页数：3

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